1-(6-bromanyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)piperidine-4-carboxamide

Systemtic Name: 1-(6-bromanyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)piperidine-4-carboxamide Openeye Name: 1-(6-bromo-1,3-benzothiazol-2-yl)-N-(2-furylmethyl)piperidine-4-carboxamide CAS Name: 1-(6-bromo-1,3-benzothiazol-2-yl)-N-(2-furanylmethyl)-4-piperidinecarboxamide IUPAC Name: 1-(6-bromo-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)piperidine-4-carboxamide Traditional Name: 1-(6-bromo-1,3-benzothiazol-2-yl)-N-(2-furfuryl)isonipecotamide Formula: C18H18BrN3O2S MolecularWeight: 420.32342

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCC2=CC=CO2)C3=NC4=C(S3)C=C(C=C4)Br

Isomeric SMILES

C1CN(CCC1C(=O)NCC2=CC=CO2)C3=NC4=C(S3)C=C(C=C4)Br

InChI

InChI=1S/C18H18BrN3O2S/c19-13-3-4-15-16(10-13)25-18(21-15)22-7-5-12(6-8-22)17(23)20-11-14-2-1-9-24-14/h1-4,9-10,12H,5-8,11H2,(H,20,23)